5-bromo-2-(5-chloro-1,3-thiazol-2-yl)pyrimidin-4-amine

C7H4BrClN4S — CID 107125371

IUPAC5-bromo-2-(5-chloro-1,3-thiazol-2-yl)pyrimidin-4-amine
SMILESNc1nc(-c2ncc(Cl)s2)ncc1Br
InChIInChI=1S/C7H4BrClN4S/c8-3-1-11-6(13-5(3)10)7-12-2-4(9)14-7/h1-2H,(H2,10,11,13)
InChIKeyGJZGRNZXDSQRKH-UHFFFAOYSA-N
MW291.56 g/mol
LogP2.60
Rot. Bonds1

About 5-bromo-2-(5-chloro-1,3-thiazol-2-yl)pyrimidin-4-amine

5-bromo-2-(5-chloro-1,3-thiazol-2-yl)pyrimidin-4-amine (PubChem CID 107125371) has the molecular formula C7H4BrClN4S and a molecular weight of 291.56 g/mol. Its IUPAC name is 5-bromo-2-(5-chloro-1,3-thiazol-2-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name5-bromo-2-(5-chloro-1,3-thiazol-2-yl)pyrimidin-4-amine
PubChem CID107125371
Molecular FormulaC7H4BrClN4S
Molecular Weight291.56 g/mol
Exact Mass289.90
IUPAC Name5-bromo-2-(5-chloro-1,3-thiazol-2-yl)pyrimidin-4-amine
SMILESNc1nc(-c2ncc(Cl)s2)ncc1Br
InChIInChI=1S/C7H4BrClN4S/c8-3-1-11-6(13-5(3)10)7-12-2-4(9)14-7/h1-2H,(H2,10,11,13)
InChIKeyGJZGRNZXDSQRKH-UHFFFAOYSA-N
XLogP2.60
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.56
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-bromo-2-(3-bromo-4-chlorophenyl)pyrimidin-4-amine
CID 115568327
2-bromo-5-chloro-1,3-thiazole
CID 18519960
2-(5-chloro-1,3-thiazol-2-yl)-6-cyclopropylpyrimidin-4-amine
CID 107125320
5-bromo-2-(2-methylthiophen-3-yl)pyrimidin-4-amine
CID 130581487
5-bromo-2-pyridin-3-ylpyrimidin-4-amine
CID 66302850
2-[5-bromo-4-chloro-6-(2-methylpropyl)pyrimidin-2-yl]-5-chloro-1,3-thiazole
CID 107124723
5-bromo-2-(5-chloro-1,3-thiazol-2-yl)-6-ethyl-N-methylpyrimidin-4-amine
CID 107125354
2-(4-tert-butyl-6-chloropyrimidin-2-yl)-5-chloro-1,3-thiazole
CID 107124671
[2-(5-chloro-1,3-thiazol-2-yl)-1,3-thiazol-5-yl]methanamine
CID 107125215
5-bromo-2-(2-bromo-3,4-difluorophenyl)pyrimidin-4-amine
CID 107539770
5-bromo-2-(5-chloro-1,3-thiazol-2-yl)-6-cyclopropyl-N-methylpyrimidin-4-amine
CID 107125379
5-bromo-2-chloropyrimidin-4-amine;oxolane
CID 143294282

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(5-chloro-1,3-thiazol-2-yl)pyrimidin-4-amine?
The IUPAC name of 5-bromo-2-(5-chloro-1,3-thiazol-2-yl)pyrimidin-4-amine (CID 107125371) is 5-bromo-2-(5-chloro-1,3-thiazol-2-yl)pyrimidin-4-amine.
What is the SMILES notation for 5-bromo-2-(5-chloro-1,3-thiazol-2-yl)pyrimidin-4-amine?
The canonical SMILES for 5-bromo-2-(5-chloro-1,3-thiazol-2-yl)pyrimidin-4-amine is Nc1nc(-c2ncc(Cl)s2)ncc1Br.
What is the InChIKey of 5-bromo-2-(5-chloro-1,3-thiazol-2-yl)pyrimidin-4-amine?
The InChIKey is GJZGRNZXDSQRKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4BrClN4S/c8-3-1-11-6(13-5(3)10)7-12-2-4(9)14-7/h1-2H,(H2,10,11,13).
What are the key properties of 5-bromo-2-(5-chloro-1,3-thiazol-2-yl)pyrimidin-4-amine?
5-bromo-2-(5-chloro-1,3-thiazol-2-yl)pyrimidin-4-amine has a molecular weight of 291.56 g/mol, XLogP of 2.60, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(5-chloro-1,3-thiazol-2-yl)pyrimidin-4-amine is sourced from PubChem (CID 107125371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).